N-methyl-3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: N-methyl-3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Openeye Name: 3-benzylsulfanyl-N-methyl-1H-1,2,4-triazol-5-amine CAS Name: N-methyl-3-(phenylmethylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-benzylsulfanyl-N-methyl-1H-1,2,4-triazol-5-amine Traditional Name: [3-(benzylthio)-1H-1,2,4-triazol-5-yl]-methyl-amine Formula: C10H12N4S MolecularWeight: 220.29408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NN1)SCC2=CC=CC=C2

Isomeric SMILES

CNC1=NC(=NN1)SCC2=CC=CC=C2

InChI

InChI=1S/C10H12N4S/c1-11-9-12-10(14-13-9)15-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,11,12,13,14)